ASE database

ID Formula distance no_equ_17 no_equ_11
1 Cu54Li 1.865 - ratio:1.25,dipole:-2.667,distance:4.858,ads_E:-0.244
2 BeCu54 1.012 ratio:1.55,dipole:-0.00631543,distance:7.10066,ads_E:-0.00261613 ratio:1.25,dipole:-0.291055,distance:3.73895,ads_E:-0.152313
3 Cu54B 0.409 ratio:2.100,dipole:-0.833,distance:11.891,ads_E:-0.007 ratio:1.250,dipole:-0.107,distance:2.976,ads_E:-0.989
4 Cu54C 0.260 ratio:1.55,dipole:3.07149,distance:5.99264,ads_E:-0.095025 ratio:1.25,dipole:1.94527,distance:2.86911,ads_E:-0.945693
5 Cu54N 0.399 ratio:1.5,dipole:0.030,distance:5.736,ads_E:-0.004 ratio:1.25,dipole:0.908,distance:3.014,ads_E:-0.162
6 Cu54O 0.772 - ratio:1.250,dipole:3.446,distance:3.499,ads_E:-0.537
7 Cu54F 1.238 - ratio:1.300,dipole:7.369,distance:4.635,ads_E:-1.125
8 Cu54Ar 3.861 ratio:1.22,dipole:0.004,distance:6.530,ads_E:-0.006 ratio:1.1,dipole:0.008,distance:4.902,ads_E:-0.012